4b,5,6,7-tetrahydrobiphenylen-2-ol

C12H12O — CID 71325377

IUPAC4b,5,6,7-tetrahydrobiphenylen-2-ol
SMILESOc1ccc2c(c1)C1=CCCCC12
InChIInChI=1S/C12H12O/c13-8-5-6-11-9-3-1-2-4-10(9)12(11)7-8/h4-7,9,13H,1-3H2
InChIKeyHNDIATSIADVWPD-UHFFFAOYSA-N
MW172.23 g/mol
LogP3.06
Rot. Bonds

About 4b,5,6,7-tetrahydrobiphenylen-2-ol

4b,5,6,7-tetrahydrobiphenylen-2-ol (PubChem CID 71325377) has the molecular formula C12H12O and a molecular weight of 172.23 g/mol. Its IUPAC name is 4b,5,6,7-tetrahydrobiphenylen-2-ol.

Molecular Properties

Compound Name4b,5,6,7-tetrahydrobiphenylen-2-ol
PubChem CID71325377
Molecular FormulaC12H12O
Molecular Weight172.23 g/mol
Exact Mass172.09
IUPAC Name4b,5,6,7-tetrahydrobiphenylen-2-ol
SMILESOc1ccc2c(c1)C1=CCCCC12
InChIInChI=1S/C12H12O/c13-8-5-6-11-9-3-1-2-4-10(9)12(11)7-8/h4-7,9,13H,1-3H2
InChIKeyHNDIATSIADVWPD-UHFFFAOYSA-N
XLogP3.06
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 4b,5,6,7-tetrahydrobiphenylen-2-ol?
The IUPAC name of 4b,5,6,7-tetrahydrobiphenylen-2-ol (CID 71325377) is 4b,5,6,7-tetrahydrobiphenylen-2-ol.
What is the SMILES notation for 4b,5,6,7-tetrahydrobiphenylen-2-ol?
The canonical SMILES for 4b,5,6,7-tetrahydrobiphenylen-2-ol is Oc1ccc2c(c1)C1=CCCCC12.
What is the InChIKey of 4b,5,6,7-tetrahydrobiphenylen-2-ol?
The InChIKey is HNDIATSIADVWPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12O/c13-8-5-6-11-9-3-1-2-4-10(9)12(11)7-8/h4-7,9,13H,1-3H2.
What are the key properties of 4b,5,6,7-tetrahydrobiphenylen-2-ol?
4b,5,6,7-tetrahydrobiphenylen-2-ol has a molecular weight of 172.23 g/mol, XLogP of 3.06, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4b,5,6,7-tetrahydrobiphenylen-2-ol is sourced from PubChem (CID 71325377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).